Basic information
- CAS
120523-16-2- Standard SMILES
O[C@@H]1CCOc2ccccc21- InChIKey
MGSHXMOLUWTMGP-MRVPVSSYSA-N- Molecular formula
- C9H10O2
- Average molar mass
- 150.17 g/mol
- Monoisotopic mass
- 150.06807956
Names & identifiers
- Preferred name
- (R)-4-Chromanol
- IUPAC
- (4R)-3,4-dihydro-2H-chromen-4-ol
- English name
- (R)-4-CHROMANOL
- Molecular formula
- C9H10O2
- Molecular weight
- 150.17
Names & synonyms
120523-16-2(R)-4-chromanolRefChem:210915(4R)-3,4-dihydro-2H-1-benzopyran-4-ol(r)-chroman-4-ol(4R)-3,4-dihydro-2H-chromen-4-olCHEMBL206124(+)-(R)-4-ChromanolSCHEMBL819188SCHEMBL29457666MGSHXMOLUWTMGP-MRVPVSSYSA-NDTXSID701317021
Show more names
SPECS 131/40242452(R)-Chroman-4-ol - [C91231]2H-1-Benzopyran-4-ol, 3,4-dihydro-, (4R)-
BDBM50183605AKOS006237644EBC-612868EN300-69615G57116Z959151866
Database identifiers
- CAS
120523-16-2- PubChem CID
- 640695
- DTXSID
DTXSID701317021- ChEMBL
CHEMBL206124- Nikkaji
- J885.042I
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 136
Physicochemical properties
- Melting point
- 68 · 68-70 °C(Solv: ethyl ether (60-29-7))
- Boiling point
- 266.6 · 266.6±29.0 °C(Predicted)
- Density
- 1.208 · 1.208±0.06 g/cm3(Predicted)
- pka
- 14.12 · 14.12±0.20(Predicted)
Chemistry & industry
Suppliers13 total
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
石家庄手性化学有限公司031185291771 13832391721 · [email protected]
上海虹晶生物科技有限公司434403602 · [email protected]
上海冉创生物科技有限公司021-18217521994; 18217521994 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
上海腾渤医药科技有限公司021-54338626 18017892860 · [email protected]
上海晶石医药科技有限公司021-000000 · [email protected]
杭州文德阶生物科技有限公司0571-86706360 18158111080 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
2 records
Compound notes
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